Jonas Greiner

Technical University of Denmark — Denmark

Physics and Astronomy · Physical Sciences

4h-index120citations21works1.52yr avg
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Research Topics

Advanced Chemical Physics Studies(10), Synthesis and Properties of Aromatic Compounds(4), Machine Learning in Materials Science(4), Crystallography and molecular interactions(2), Fullerene Chemistry and Applications(2)

Publications21 total

eriksen-lab/opentrustregion: v2.0.1
Zenodo (CERN European Organization for Nuclear Research)·2026Open Access
Solvation Lies Within: Simulating Condensed-Phase Properties from Local Electronic Structures
ArXiv.org·2026Open Access
A Reusable Library for Second-Order Orbital Optimization Using the Trust Region Method
Journal of Chemical Theory and Computation·2026· 1 cited
Solvation Lies Within: Simulating Condensed-Phase Properties from Local Electronic Structures
arXiv (Cornell University)·2026Open Access
fishjojo/pyscfad: pyscfad release v0.2.0
Zenodo (CERN European Organization for Nuclear Research)·2025Open Access
A Reusable Library for Second-Order Orbital Optimization Using the Trust Region Method
arXiv (Cornell University)·2025Open Access
Exploiting Non-Abelian Point-Group Symmetry to Estimate the Exact Ground-State Correlation Energy of Benzene in a Polarized Split-Valence Triple-Zeta Basis Set
The Journal of Physical Chemistry Letters·2024· 1 cited
Error Control and Automatic Detection of Reference Active Spaces in Many-Body Expanded Full Configuration Interaction
The Journal of Physical Chemistry A·2024· 4 cited
Exploiting Non-Abelian Point-Group Symmetry to Estimate the Exact Ground-State Correlation Energy of Benzene in a Polarized Split-Valence Triple-Zeta Basis Set
arXiv (Cornell University)·2024Open Access
Error Control and Automatic Detection of Reference Active Spaces in Many-Body Expanded Full Configuration Interaction
arXiv (Cornell University)·2024Open Access
MBE-CASSCF Approach for the Accurate Treatment of Large Active Spaces
Journal of Chemical Theory and Computation·2024· 10 citedOpen Access
Symmetrization of Localized Molecular Orbitals
The Journal of Physical Chemistry A·2023· 3 cited
Symmetrization of Localized Molecular Orbitals
arXiv (Cornell University)·2023Open Access
Photophysical properties of the triangular [Au(HNCOH)]<sub>3</sub> complex and its dimer
Physical Chemistry Chemical Physics·2020· 4 citedOpen Access
Correction: Calculation of vibrationally resolved absorption and fluorescence spectra of the rylenes
Physical Chemistry Chemical Physics·2020Open Access
Calculation of vibrationally resolved absorption and fluorescence spectra of the rylenes
Physical Chemistry Chemical Physics·2020· 18 citedOpen Access
A high torque, wide air gap bearingless motor with permanent magnet free rotor
2017· 4 cited
Gas Absorption by Vacuum Evaporated Magnetic Films
Elsevier eBooks·2013· 1 cited
GRB 110625A: GROND detection of a source inside the XRT error circle.
GCN·2011
Two absorption systems in GRB 030226.
GCN·2003· 2 cited
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Frequent Co-authors

Janus J. Eriksen(11), Jürgen Gauß(5), Dage Sundholm(3), Ida‐Marie Høyvik(2), Susi Lehtola(2), Kasper F. Schaltz(2), Filippo Lipparini(2), Claudia D. Tesche(1), Kenneth R. Brown(1), Alesandro Callegari(1), M. Chen(1), H. C. Jones(1), M. B. Ketchen(1), K. Kim(1), A. W. Kleinsasser(1), H. Notarys(1), G. R. Proto(1), R. Wang(1), T. Yogi(1), Ivan Giannì(1)